propan-2-yl 2,2-dimethyl-5-[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]-3-oxidanylidene-pentanoate

Systemtic Name: propan-2-yl 2,2-dimethyl-5-[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]-3-oxidanylidene-pentanoate Openeye Name: isopropyl 2,2-dimethyl-5-[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]-3-oxo-pentanoate CAS Name: 2,2-dimethyl-5-[3-(1-methyl-2-imidazolyl)-2-phenethyl-2H-1-benzopyran-6-yl]-3-oxopentanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 2,2-dimethyl-5-[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]-3-oxopentanoate Traditional Name: 3-keto-2,2-dimethyl-5-[3-(1-methylimidazol-2-yl)-2-phenethyl-2H-chromen-6-yl]valeric acid isopropyl ester Formula: C31H36N2O4 MolecularWeight: 500.62854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(=O)C(C)(C)C(=O)CCC1=CC2=C(C=C1)OC(C(=C2)C3=NC=CN3C)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)OC(=O)C(C)(C)C(=O)CCC1=CC2=C(C=C1)OC(C(=C2)C3=NC=CN3C)CCC4=CC=CC=C4

InChI

InChI=1S/C31H36N2O4/c1-21(2)36-30(35)31(3,4)28(34)16-13-23-12-14-26-24(19-23)20-25(29-32-17-18-33(29)5)27(37-26)15-11-22-9-7-6-8-10-22/h6-10,12,14,17-21,27H,11,13,15-16H2,1-5H3